CHEMBL363419
SMILES | c1ccc(Oc2nc3ncnc-3c(NC3CCCCC3)[nH]2)cc1 |
InChIKey | OGCQBCHLFMBCCE-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 2 |
Rotatable bonds | 4 |
Molecular weight (Da) | 309.2 |
Drug properties
Molecular type | Small molecule |
Physiological/Surrogate | Surrogate |
Approved drug | No |
Database connections
Bioactivities
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
A3 | AA3R | Human | Adenosine | A | pKi | 7.33 | 7.33 | 7.33 | ChEMBL |
A1 | AA1R | Human | Adenosine | A | pKi | 4.58 | 4.58 | 4.58 | ChEMBL |
A2A | AA2AR | Human | Adenosine | A | pKi | 4.8 | 4.8 | 4.8 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |